Home Fluorides 454-91-1
454-91-1,MFCD00021868
Catalog No.:AA003DQG

454-91-1 | Alpha-methyl-3-(trifluoromethyl)benzyl alcohol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
>97%
in stock  
$20.00   $14.00
- +
5g
97%
in stock  
$33.00   $23.00
- +
25g
97%
in stock  
$139.00   $97.00
- +
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Technical Information
Catalog Number:
AA003DQG
Chemical Name:
Alpha-methyl-3-(trifluoromethyl)benzyl alcohol
CAS Number:
454-91-1
Molecular Formula:
C9H9F3O
Molecular Weight:
190.1624
MDL Number:
MFCD00021868
SMILES:
CC(c1cccc(c1)C(F)(F)F)O
Properties
Properties
 
BP:
206.9°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
n20/D 1.458(lit.)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
167  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
2.3  

Literature
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Additional Info:
SDS
Tags:454-91-1 Molecular Formula|454-91-1 MDL|454-91-1 SMILES|454-91-1 Alpha-methyl-3-(trifluoromethyl)benzyl alcohol